Application of explicitly correlated coupled-cluster methods to molecules containing post-3d main group elements
Author:
Affiliation:
1. a Department of Chemistry , Washington State University , Pullman , Washington 99164-4630 , USA
2. b Institut für Theoretische Chemie, Universität Stuttgart , Pfaffenwaldring 55, D-70569 Stuttgart , Germany
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
https://www.tandfonline.com/doi/pdf/10.1080/00268976.2011.624129
Reference71 articles.
1. A simple and efficient CCSD(T)-F12 approximation
2. Simplified CCSD(T)-F12 methods: Theory and benchmarks
3. Communications: Accurate and efficient approximations to explicitly correlated coupled-cluster singles and doubles, CCSD-F12
4. Accurate calculation of vibrational frequencies using explicitly correlated coupled-cluster theory
5. Accurate Calculations of Intermolecular Interaction Energies Using Explicitly Correlated Coupled Cluster Wave Functions and a Dispersion-Weighted MP2 Method
Cited by 33 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Correlation Consistent Basis Sets for Explicitly Correlated Theory: The Transition Metals;Journal of Chemical Theory and Computation;2023-08-04
2. Atomic Mean-Field Approach within Exact Two-Component Theory Based on the Dirac–Coulomb–Breit Hamiltonian;The Journal of Physical Chemistry A;2022-06-28
3. Fluoro‐nitrogen Cations;Angewandte Chemie International Edition;2022-01-10
4. Fluoro‐nitrogen Cations;Angewandte Chemie;2022-01-10
5. Correlation consistent basis sets for explicitly correlated wavefunctions: Pseudopotential-based basis sets for the group 11 (Cu, Ag, Au) and 12 (Zn, Cd, Hg) elements;The Journal of Chemical Physics;2021-11-07
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3